4-tert-butyl-N-(3-phenylsulfanylpropyl)benzenecarbothioamide

Systemtic Name: 4-tert-butyl-N-(3-phenylsulfanylpropyl)benzenecarbothioamide Openeye Name: 4-tert-butyl-N-(3-phenylsulfanylpropyl)benzenecarbothioamide CAS Name: 4-tert-butyl-N-[3-(phenylthio)propyl]benzenecarbothioamide IUPAC Name: 4-tert-butyl-N-(3-phenylsulfanylpropyl)benzenecarbothioamide Traditional Name: 4-tert-butyl-N-[3-(phenylthio)propyl]thiobenzamide Formula: C20H25NS2 MolecularWeight: 343.5492

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=S)NCCCSC2=CC=CC=C2

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=S)NCCCSC2=CC=CC=C2

InChI

InChI=1S/C20H25NS2/c1-20(2,3)17-12-10-16(11-13-17)19(22)21-14-7-15-23-18-8-5-4-6-9-18/h4-6,8-13H,7,14-15H2,1-3H3,(H,21,22)